1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine

C16H19N — CID 61034041

IUPAC1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine
SMILESCNCc1cccc(-c2ccc(C)c(C)c2)c1
InChIInChI=1S/C16H19N/c1-12-7-8-16(9-13(12)2)15-6-4-5-14(10-15)11-17-3/h4-10,17H,11H2,1-3H3
InChIKeyHCMDGDTUEHOJTI-UHFFFAOYSA-N
MW225.33 g/mol
LogP3.69
Rot. Bonds3

About 1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine

1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine (PubChem CID 61034041) has the molecular formula C16H19N and a molecular weight of 225.33 g/mol. Its IUPAC name is 1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine
PubChem CID61034041
Molecular FormulaC16H19N
Molecular Weight225.33 g/mol
Exact Mass225.15
IUPAC Name1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine
SMILESCNCc1cccc(-c2ccc(C)c(C)c2)c1
InChIInChI=1S/C16H19N/c1-12-7-8-16(9-13(12)2)15-6-4-5-14(10-15)11-17-3/h4-10,17H,11H2,1-3H3
InChIKeyHCMDGDTUEHOJTI-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[3-(4-methoxy-3-methylphenyl)phenyl]-N-methylmethanamine
CID 61034321
[3-[3-(methylaminomethyl)phenyl]phenyl]methanamine
CID 58788121
N-methyl-1-[3-(3,4,5-trifluorophenyl)phenyl]methanamine
CID 61239496
N-methyl-1-[4-methyl-3-(3-propylphenyl)phenyl]methanamine
CID 105409508
1-[3-(2-methoxy-4,6-dimethylphenyl)phenyl]-N-methylmethanamine
CID 106681069
N-[[3-(4-methoxy-3-methylphenyl)phenyl]methyl]propan-2-amine
CID 61034457
N-[[3-(3-fluoro-4-methylphenyl)phenyl]methyl]ethanamine
CID 113324415
N-methyl-1-[3-(1-methylimidazol-2-yl)phenyl]methanamine
CID 58113407
N-[[3-(3-fluoro-4-methylphenyl)phenyl]methyl]propan-2-amine
CID 115502487
N-methyl-1-[3-methyl-4-(3-methylphenyl)phenyl]methanamine
CID 66480423
1-[2-(3,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-N-methylmethanamine
CID 82357631
1-[5-(3-ethylphenyl)-3-pyridinyl]-N-methylmethanamine
CID 113469756

Frequently Asked Questions

What is the IUPAC name of 1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine?
The IUPAC name of 1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine (CID 61034041) is 1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine is CNCc1cccc(-c2ccc(C)c(C)c2)c1.
What is the InChIKey of 1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine?
The InChIKey is HCMDGDTUEHOJTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-12-7-8-16(9-13(12)2)15-6-4-5-14(10-15)11-17-3/h4-10,17H,11H2,1-3H3.
What are the key properties of 1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine?
1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine has a molecular weight of 225.33 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(3,4-dimethylphenyl)phenyl]-N-methylmethanamine is sourced from PubChem (CID 61034041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).